SCHEMBL9115745

SCHEMBL9115745

O=PCc1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKAA2 P54646 1/20 0.72
RXRA P19793 2/20 0.53
NR1I2 O75469 1/20 0.50
NR4A2 P43354 1/20 0.50
PDE4D Q08499 1/20 0.50
HMGCR P04035 2/20 0.48
TNKS O95271 1/20 0.39
TNKS2 Q9H2K2 1/20 0.39
PARP2 Q9UGN5 1/20 0.39
FABP4 P15090 1/20 0.37
FABP5 Q01469 1/20 0.37
ADORA2A P29274 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
KMT2A Q03164 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
BCHE P06276 1/20 0.36
ACHE P22303 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14749820 0.84 PRKAA2 (0.77) PRKAA2RXRANR1I2NR4A2PDE4D
SCHEMBL30060873 0.84 PRKAA2 (1.00) PRKAA2RXRANR1I2NR4A2PDE4D
SCHEMBL29419455 0.84 PRKAA2 (0.77) PRKAA2RXRANR1I2NR4A2PDE4D
SCHEMBL24454 0.84 PRKAA2 (0.77) PRKAA2RXRANR1I2NR4A2PDE4D
SCHEMBL3709827 0.84 PRKAA2 (0.77) PRKAA2RXRANR1I2NR4A2PDE4D
SCHEMBL29419156 0.84 PRKAA2 (0.77) PRKAA2RXRANR1I2NR4A2PDE4D
SCHEMBL31546 0.84 PRKAA2 (1.00) PRKAA2RXRANR1I2NR4A2PDE4D
SCHEMBL14753495 0.84 PRKAA2 (0.77) PRKAA2RXRANR1I2NR4A2PDE4D
SCHEMBL9115766 0.83 PRKAA2 (0.72) PRKAA2RXRANR1I2NR4A2PDE4D
SCHEMBL27936537 0.83 PRKAA2 (0.76) PRKAA2RXRANR1I2NR4A2PDE4D

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1995011898-A1 CONDENSED PYRIDINE TYPE MEVALONOLACTONE INTERMEDIATE AND PROCESS FOR ITS PRODUCTION NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1995-05-04 WO disclosed